disodium (4Z)-4-[(6-chloranyl-1H-indazol-3-yl)hydrazinylidene]-3-oxidanylidene-naphthalene-2,7-disulfonate

Systemtic Name: disodium (4Z)-4-[(6-chloranyl-1H-indazol-3-yl)hydrazinylidene]-3-oxidanylidene-naphthalene-2,7-disulfonate Openeye Name: disodium (4Z)-4-[(6-chloro-1H-indazol-3-yl)hydrazono]-3-oxo-naphthalene-2,7-disulfonate CAS Name: disodium (4Z)-4-[(6-chloro-1H-indazol-3-yl)hydrazinylidene]-3-oxonaphthalene-2,7-disulfonate IUPAC Name: disodium (4Z)-4-[(6-chloro-1H-indazol-3-yl)hydrazinylidene]-3-oxonaphthalene-2,7-disulfonate Traditional Name: disodium (4Z)-4-[(6-chloro-1H-indazol-3-yl)hydrazono]-3-keto-naphthalene-2,7-disulfonate Formula: C17H9ClN4Na2O7S2 MolecularWeight: 526.8385

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)[O-])C=C(C(=O)C2=NNC3=NNC4=C3C=CC(=C4)Cl)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC\2=C(C=C1S(=O)(=O)[O-])C=C(C(=O)/C2=N\NC3=NNC4=C3C=CC(=C4)Cl)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C17H11ClN4O7S2.2Na/c18-9-1-3-12-13(7-9)19-21-17(12)22-20-15-11-4-2-10(30(24,25)26)5-8(11)6-14(16(15)23)31(27,28)29;;/h1-7H,(H2,19,21,22)(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2/b20-15-;;